2-[[3-(4-tert-butylphenyl)-1-(2-cyanoethyl)pyrazol-4-yl]methylidene]propanedinitrile

Systemtic Name: 2-[[3-(4-tert-butylphenyl)-1-(2-cyanoethyl)pyrazol-4-yl]methylidene]propanedinitrile Openeye Name: 2-[[3-(4-tert-butylphenyl)-1-(2-cyanoethyl)pyrazol-4-yl]methylene]propanedinitrile CAS Name: 2-[[3-(4-tert-butylphenyl)-1-(2-cyanoethyl)-4-pyrazolyl]methylidene]propanedinitrile IUPAC Name: 2-[[3-(4-tert-butylphenyl)-1-(2-cyanoethyl)pyrazol-4-yl]methylidene]propanedinitrile Traditional Name: 2-[[3-(4-tert-butylphenyl)-1-(2-cyanoethyl)pyrazol-4-yl]methylene]malononitrile Formula: C20H19N5 MolecularWeight: 329.39836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C#N)CCC#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C#N)CCC#N

InChI

InChI=1S/C20H19N5/c1-20(2,3)18-7-5-16(6-8-18)19-17(11-15(12-22)13-23)14-25(24-19)10-4-9-21/h5-8,11,14H,4,10H2,1-3H3